CAS Registry Number: 645418-66-2

Name:

2(1H)​-​Isoquinolinecarboxyl​ic acid, 7-​amino-​3,​4-​dihydro-​4,​4-​dimethyl-​, 1,​1-​dimethylethyl ester
7-​Amino-​4,​4-​dimethyl-​3,​4-​dihydro-​1H-​isoquinoline-​2-​carboxylic acid tert-​butyl ester; tert-​Butyl 7-​amino-​4,​4-​dimethyl-​3,​4-​dihydroisoquinoline-​2(1H)​-​carboxylate 

Chemical Formula: C16H24N2O2
Exact Mass: 276.18
Molecular Weight: 276.37
m/z: 276.18 (100.0%), 277.19 (17.7%), 278.19 (1.9%)

InChI: InChI=1S/C16H24N2O2/c1-15(2,3)20-14(19)18-9-11-8-12(17)6-7-13(11)16(4,5)10-18/h6-8H,9-10,17H2,1-5H3
InChIKey: AIHKRQNBHDKCFX-UHFFFAOYSA-N
Canonical SMILES : CC1(CN(CC2=C1C=CC(=C2)N)C(=O)OC(C)(C)C)C

Specification

98%

PCT Int. Appl. (2013), WO 2013126656 A1 20130829.                                  

PCT Int. Appl. (2013), WO 2013059485 A1 20130425.